%chk=000121168.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000121168

0 1
 S    3.037200     -0.5852000      3.9999999E-04
 O   -1.318700      -2.180100      6.0000003E-04
 N   -1.286100       1.580100       0.000000    
 C   0.4771000     -0.5187000     -3.9999999E-04
 C   0.9212000      0.8462000       0.000000    
 C  -0.8580000     -0.9061000     -5.0000002E-04
 C   -1.669000      0.2419000     -1.9999999E-04
 C   4.2399999E-02   1.926400      1.9999999E-04
 C    1.522500      -1.408300     -3.0000001E-04
 C    2.286800      0.9662000      9.9999997E-05
 C   -3.155300      3.7500001E-02  1.9999999E-04
 H   0.2937000       2.976900      3.9999999E-04
 H    1.512900      -2.489300     -5.0000002E-04
 H    2.892200       1.862500      3.0000001E-04
 H   -3.464000     -0.5151000      0.8933000    
 H   -3.684300      0.9964000       0.000000    
 H   -3.464400     -0.5155000     -0.8926000    
 H  -0.5720000      -2.800100      6.9999998E-04


%chk=000121168-Freq.chk
%nprocshared=12
%mem=21GB
#p freq=noraman PBEPBE/SDD

000121168

0 1
S 3.199894 -0.597516 -0.000335
O -1.385896 -2.106306 0.000089
N -1.324236 1.596581 0.000124
C 0.562959 -0.550941 0.000033
C 0.997278 0.850970 0.000048
C -0.858657 -0.803393 0.000080
C -1.760495 0.266828 0.000133
C -0.017270 1.878901 0.000108
C 1.635484 -1.453087 0.000021
C 2.390610 0.985849 0.000128
C -3.252573 0.033556 0.000189
H 0.265330 2.938031 0.000210
H 1.645792 -2.541957 0.000034
H 2.989640 1.894266 0.000228
H -3.568926 -0.547433 0.886224
H -3.767512 1.006319 -0.000175
H -3.568882 -0.548127 -0.885400
H -0.668340 -2.786840 -0.000042


